2-(1-hydroxyethyl)-5-methoxy-3-methylphenol

C10H14O3 — CID 178064841

IUPAC2-(1-hydroxyethyl)-5-methoxy-3-methylphenol
SMILESCOc1cc(C)c(C(C)O)c(O)c1
InChIInChI=1S/C10H14O3/c1-6-4-8(13-3)5-9(12)10(6)7(2)11/h4-5,7,11-12H,1-3H3
InChIKeyZFORJHYIMCNFEB-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.76
Rot. Bonds2

About 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol

2-(1-hydroxyethyl)-5-methoxy-3-methylphenol (PubChem CID 178064841) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol.

Molecular Properties

Compound Name2-(1-hydroxyethyl)-5-methoxy-3-methylphenol
PubChem CID178064841
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name2-(1-hydroxyethyl)-5-methoxy-3-methylphenol
SMILESCOc1cc(C)c(C(C)O)c(O)c1
InChIInChI=1S/C10H14O3/c1-6-4-8(13-3)5-9(12)10(6)7(2)11/h4-5,7,11-12H,1-3H3
InChIKeyZFORJHYIMCNFEB-UHFFFAOYSA-N
XLogP1.76
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-3-methyl-2-propan-2-ylphenol
CID 90394378
2-(1-hydroxyethyl)-3-(hydroxymethyl)-5-methoxyphenol
CID 130036156
2-chloro-5-methoxy-3-methylphenol
CID 144544904
1-(4-methoxy-2,6-dimethylphenyl)-2-(propan-2-ylamino)propan-1-ol
CID 82315867
1-(4-methoxy-2,6-dimethylphenyl)-2-(propan-2-ylamino)ethanol
CID 82315829
1-(4-methoxy-2,6-dimethylphenyl)-2-(methylamino)ethanol
CID 82315849
1-(2,4-dimethoxy-6-methylphenyl)-1-(methylamino)propan-2-ol
CID 116859497
1-(4-methoxy-2,6-dimethylphenyl)butane-1,2,4-triol
CID 171872645
2-hydroxy-4-methoxy-6-methylbenzaldehyde
CID 596815
1-(2-bromo-4,6-dimethoxyphenyl)ethanol
CID 84710416
2-(ethylamino)-1-(4-methoxy-2,6-dimethylphenyl)-3-methylbutan-1-ol
CID 82315899
1-(4-methoxy-2,6-dimethylphenyl)-2-(propan-2-ylamino)butan-1-ol
CID 82315890

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol?
The IUPAC name of 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol (CID 178064841) is 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol.
What is the SMILES notation for 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol?
The canonical SMILES for 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol is COc1cc(C)c(C(C)O)c(O)c1.
What is the InChIKey of 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol?
The InChIKey is ZFORJHYIMCNFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-6-4-8(13-3)5-9(12)10(6)7(2)11/h4-5,7,11-12H,1-3H3.
What are the key properties of 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol?
2-(1-hydroxyethyl)-5-methoxy-3-methylphenol has a molecular weight of 182.22 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxyethyl)-5-methoxy-3-methylphenol is sourced from PubChem (CID 178064841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).